## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
E |
122 |
30 |
6552 |
◊ |
D |
x,y,z |
1_555 |
131 |
35 |
6488 |
1289.1 |
-10.3 |
0.300 |
24 |
8 |
0 |
1.000 |
2 |
|
H |
124 |
31 |
6591 |
◊ |
G |
x,y,z |
1_555 |
128 |
35 |
6638 |
1262.9 |
-9.8 |
0.282 |
22 |
8 |
0 |
1.000 |
3 |
|
G |
116 |
28 |
6638 |
◊ |
F |
x,y,z |
1_555 |
121 |
35 |
6514 |
1246.2 |
-10.0 |
0.266 |
22 |
10 |
0 |
1.000 |
4 |
|
F |
110 |
28 |
6514 |
◊ |
E |
x,y,z |
1_555 |
125 |
35 |
6552 |
1237.1 |
-11.2 |
0.225 |
24 |
8 |
0 |
1.000 |
5 |
|
H |
125 |
35 |
6591 |
◊ |
D |
x,y,z |
1_555 |
115 |
29 |
6488 |
1234.2 |
-10.7 |
0.242 |
23 |
8 |
0 |
1.000 |
Average: |
1253.9 |
-10.4 |
0.263 |
23 |
8 |
0 |
1.000 |
2 |
6 |
|
H |
39 |
13 |
6591 |
◊ |
G |
-x+1/2,y-1/2,-z+1 |
4_546 |
37 |
12 |
6638 |
320.0 |
-1.6 |
0.533 |
3 |
0 |
0 |
0.000 |
3 |
7 |
|
[233]D:2203 |
21 |
1 |
575 |
◊ |
H |
-x,y,-z |
2_555 |
34 |
10 |
6591 |
251.6 |
3.4 |
0.486 |
6 |
0 |
0 |
0.000 |
8 |
|
[233]E:1206 |
21 |
1 |
580 |
◊ |
G |
-x,y,-z |
2_555 |
30 |
10 |
6638 |
251.3 |
2.2 |
0.446 |
6 |
0 |
0 |
0.000 |
Average: |
251.5 |
2.8 |
0.466 |
6 |
0 |
0 |
0.000 |
4 |
9 |
|
[233]F:1207 |
20 |
1 |
576 |
◊ |
F |
x,y,z |
1_555 |
32 |
9 |
6514 |
234.2 |
2.4 |
0.460 |
6 |
0 |
0 |
0.003 |
5 |
10 |
|
[233]D:2201 |
17 |
1 |
571 |
◊ |
D |
x,y,z |
1_555 |
32 |
10 |
6488 |
234.1 |
3.1 |
0.601 |
5 |
0 |
0 |
0.000 |
6 |
11 |
|
[233]E:1204 |
16 |
1 |
573 |
f |
E |
x,y,z |
1_555 |
29 |
9 |
6552 |
200.1 |
3.7 |
0.660 |
4 |
0 |
0 |
0.000 |
7 |
12 |
|
D |
20 |
8 |
6488 |
◊ |
G |
x-1/2,y-1/2,z |
3_445 |
23 |
7 |
6638 |
178.3 |
-0.1 |
0.641 |
2 |
0 |
0 |
0.000 |
13 |
|
E |
18 |
6 |
6552 |
◊ |
H |
x-1/2,y+1/2,z |
3_455 |
22 |
7 |
6591 |
168.3 |
-0.1 |
0.648 |
2 |
0 |
0 |
0.000 |
Average: |
173.3 |
-0.1 |
0.645 |
2 |
0 |
0 |
0.000 |
8 |
14 |
|
[SQ]E:1205 |
10 |
1 |
327 |
◊ |
G |
-x,y,-z |
2_555 |
21 |
7 |
6638 |
144.3 |
4.3 |
0.263 |
2 |
0 |
0 |
0.000 |
9 |
15 |
|
D |
16 |
5 |
6488 |
◊ |
E |
-x-1/2,y-1/2,-z |
4_445 |
18 |
4 |
6552 |
133.2 |
-0.6 |
0.578 |
1 |
0 |
0 |
0.000 |
10 |
16 |
|
[SQ]D:2202 |
7 |
1 |
425 |
cf |
[233]D:2203 |
x,y,z |
1_555 |
10 |
1 |
575 |
112.9 |
3.8 |
0.185 |
0 |
0 |
0 |
0.000 |
11 |
17 |
|
H |
15 |
5 |
6591 |
◊ |
F |
x,y-1,z |
1_545 |
12 |
6 |
6514 |
105.6 |
-0.5 |
0.553 |
1 |
0 |
0 |
0.000 |
12 |
18 |
|
F |
11 |
6 |
6514 |
◊ |
F |
-x,y,-z |
2_555 |
11 |
6 |
6514 |
96.1 |
0.7 |
0.734 |
0 |
0 |
0 |
0.000 |
13 |
19 |
|
[SQ]E:1205 |
9 |
1 |
327 |
cf |
[233]E:1204 |
x,y,z |
1_555 |
10 |
1 |
573 |
85.6 |
2.1 |
0.042 |
0 |
0 |
0 |
0.000 |
14 |
20 |
|
[233]D:2201 |
8 |
1 |
571 |
◊ |
H |
-x,y,-z |
2_555 |
10 |
4 |
6591 |
79.5 |
-1.7 |
0.157 |
0 |
0 |
0 |
0.017 |
15 |
21 |
|
D |
13 |
6 |
6488 |
◊ |
D |
-x,y,-z |
2_555 |
13 |
6 |
6488 |
77.8 |
0.1 |
0.647 |
0 |
0 |
0 |
0.000 |
16 |
22 |
|
[SQ]D:2202 |
7 |
1 |
425 |
◊ |
E |
-x-1/2,y-1/2,-z |
4_445 |
8 |
4 |
6552 |
67.9 |
2.2 |
0.050 |
1 |
0 |
0 |
0.000 |
17 |
23 |
|
F |
9 |
5 |
6514 |
◊ |
F |
-x,y,-z+1 |
2_556 |
8 |
4 |
6514 |
61.6 |
3.0 |
0.945 |
0 |
0 |
0 |
0.000 |
24 |
|
G |
6 |
4 |
6638 |
◊ |
E |
-x,y,-z+1 |
2_556 |
6 |
4 |
6552 |
52.5 |
1.9 |
0.802 |
0 |
0 |
0 |
0.000 |
25 |
|
H |
4 |
3 |
6591 |
◊ |
D |
-x,y,-z+1 |
2_556 |
7 |
4 |
6488 |
30.2 |
1.0 |
0.787 |
0 |
0 |
0 |
0.000 |
Average: |
48.1 |
2.0 |
0.845 |
0 |
0 |
0 |
0.000 |
18 |
26 |
|
[SQ]D:2202 |
1 |
1 |
425 |
cf |
[233]D:2201 |
x,y,z |
1_555 |
5 |
1 |
571 |
59.3 |
2.2 |
0.414 |
0 |
0 |
0 |
0.000 |
19 |
27 |
|
[CYN]F:1208 |
2 |
1 |
151 |
f |
[CYN]F:1208 |
-x,y,-z |
2_555 |
2 |
1 |
151 |
58.6 |
-0.4 |
0.750 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
G |
7 |
2 |
6638 |
◊ |
E |
-x,y,-z |
2_555 |
7 |
2 |
6552 |
56.1 |
1.3 |
0.811 |
2 |
0 |
0 |
0.000 |
21 |
29 |
|
D |
9 |
4 |
6488 |
◊ |
[233]E:1206 |
-x-1/2,y-1/2,-z |
4_445 |
7 |
1 |
580 |
54.0 |
1.5 |
0.602 |
0 |
0 |
0 |
0.000 |
30 |
|
[233]D:2203 |
6 |
1 |
575 |
◊ |
E |
-x-1/2,y-1/2,-z |
4_445 |
7 |
4 |
6552 |
41.1 |
1.1 |
0.542 |
0 |
0 |
0 |
0.000 |
Average: |
47.6 |
1.3 |
0.572 |
0 |
0 |
0 |
0.000 |
22 |
31 |
|
[233]E:1204 |
6 |
1 |
573 |
◊ |
G |
-x,y,-z |
2_555 |
4 |
2 |
6638 |
52.9 |
-0.9 |
0.219 |
0 |
0 |
0 |
0.009 |
23 |
32 |
|
[233]D:2203 |
4 |
1 |
575 |
f |
[233]D:2201 |
x,y,z |
1_555 |
5 |
1 |
571 |
52.4 |
-1.1 |
0.139 |
0 |
0 |
0 |
0.011 |
24 |
33 |
|
[SQ]E:1205 |
2 |
1 |
327 |
cf |
[233]E:1206 |
x,y,z |
1_555 |
4 |
1 |
580 |
50.3 |
0.4 |
0.208 |
0 |
0 |
0 |
0.000 |
25 |
34 |
|
[233]F:1207 |
4 |
1 |
576 |
f |
[233]F:1207 |
-x,y,-z |
2_555 |
4 |
1 |
576 |
46.7 |
-1.4 |
0.121 |
0 |
0 |
0 |
0.007 |
26 |
35 |
|
[CYN]F:1208 |
2 |
1 |
151 |
cf |
[233]F:1207 |
x,y,z |
1_555 |
5 |
1 |
576 |
44.9 |
-1.3 |
0.287 |
0 |
0 |
0 |
0.006 |
27 |
36 |
|
H |
5 |
2 |
6591 |
◊ |
D |
-x,y,-z |
2_555 |
5 |
2 |
6488 |
44.6 |
-0.6 |
0.388 |
0 |
0 |
0 |
0.006 |
28 |
37 |
|
[CYN]F:1208 |
2 |
1 |
151 |
cf |
[233]F:1207 |
-x,y,-z |
2_555 |
5 |
1 |
576 |
44.5 |
-1.3 |
0.295 |
0 |
0 |
0 |
0.006 |
29 |
38 |
|
F |
4 |
1 |
6514 |
◊ |
E |
-x,y,-z |
2_555 |
7 |
2 |
6552 |
42.7 |
-0.6 |
0.435 |
0 |
0 |
0 |
0.006 |
30 |
39 |
|
G |
3 |
1 |
6638 |
x |
G |
-x+1/2,y-1/2,-z+1 |
4_546 |
6 |
3 |
6638 |
39.2 |
0.4 |
0.720 |
0 |
0 |
0 |
0.000 |
40 |
|
H |
8 |
3 |
6591 |
x |
F |
-x+1/2,y-1/2,-z+1 |
4_546 |
3 |
1 |
6514 |
32.9 |
0.3 |
0.694 |
0 |
0 |
0 |
0.000 |
Average: |
36.0 |
0.3 |
0.707 |
0 |
0 |
0 |
0.000 |
31 |
41 |
|
[233]E:1206 |
2 |
1 |
580 |
f |
[233]E:1204 |
x,y,z |
1_555 |
1 |
1 |
573 |
37.4 |
-1.5 |
0.084 |
0 |
0 |
0 |
0.015 |
32 |
42 |
|
[SQ]D:2202 |
2 |
1 |
425 |
◊ |
H |
-x,y,-z |
2_555 |
7 |
4 |
6591 |
33.4 |
1.0 |
0.481 |
0 |
0 |
0 |
0.000 |
33 |
43 |
|
H |
4 |
1 |
6591 |
◊ |
E |
-x,y,-z |
2_555 |
2 |
1 |
6552 |
32.0 |
0.4 |
0.762 |
1 |
1 |
0 |
0.002 |
34 |
44 |
|
[233]D:2201 |
3 |
1 |
571 |
f |
E |
x,y,z |
1_555 |
6 |
4 |
6552 |
29.9 |
0.2 |
0.490 |
0 |
0 |
0 |
0.000 |
35 |
45 |
|
[233]D:2201 |
4 |
1 |
571 |
◊ |
D |
-x,y,-z |
2_555 |
2 |
1 |
6488 |
26.9 |
1.1 |
0.547 |
0 |
0 |
0 |
0.000 |
36 |
46 |
|
[233]E:1206 |
2 |
1 |
580 |
◊ |
H |
-x,y,-z |
2_555 |
5 |
3 |
6591 |
19.1 |
0.3 |
0.511 |
0 |
0 |
0 |
0.000 |
47 |
|
[233]D:2203 |
2 |
1 |
575 |
◊ |
D |
-x,y,-z |
2_555 |
4 |
3 |
6488 |
16.6 |
0.3 |
0.508 |
0 |
0 |
0 |
0.000 |
Average: |
17.8 |
0.3 |
0.509 |
0 |
0 |
0 |
0.000 |
37 |
48 |
|
[233]E:1204 |
2 |
1 |
573 |
◊ |
F |
x,y,z |
1_555 |
5 |
3 |
6514 |
18.6 |
0.3 |
0.514 |
0 |
0 |
0 |
0.000 |
38 |
49 |
|
[233]F:1207 |
2 |
1 |
576 |
◊ |
G |
x,y,z |
1_555 |
4 |
3 |
6638 |
17.4 |
0.3 |
0.495 |
0 |
0 |
0 |
0.000 |
39 |
50 |
|
D |
4 |
4 |
6488 |
◊ |
[233]E:1204 |
-x-1/2,y-1/2,-z |
4_445 |
2 |
1 |
573 |
17.2 |
-0.4 |
0.310 |
0 |
0 |
0 |
0.000 |
40 |
51 |
|
[SQ]E:1205 |
1 |
1 |
327 |
f |
E |
x,y,z |
1_555 |
2 |
1 |
6552 |
15.2 |
-0.1 |
0.335 |
0 |
0 |
0 |
0.000 |
41 |
52 |
|
[233]F:1207 |
3 |
1 |
576 |
◊ |
F |
-x,y,-z |
2_555 |
2 |
1 |
6514 |
14.8 |
-0.7 |
0.214 |
0 |
0 |
0 |
0.007 |
42 |
53 |
|
[CYN]F:1208 |
1 |
1 |
151 |
f |
F |
-x,y,-z |
2_555 |
1 |
1 |
6514 |
5.4 |
-0.2 |
0.399 |
0 |
0 |
0 |
0.000 |
43 |
54 |
|
[CYN]F:1208 |
1 |
1 |
151 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
6514 |
5.2 |
-0.2 |
0.411 |
0 |
0 |
0 |
0.000 |
44 |
55 |
|
H |
1 |
1 |
6591 |
◊ |
H |
-x,y,-z+1 |
2_556 |
1 |
1 |
6591 |
4.0 |
0.1 |
0.758 |
0 |
0 |
0 |
0.000 |
56 |
|
G |
1 |
1 |
6638 |
◊ |
D |
-x,y,-z+1 |
2_556 |
1 |
1 |
6488 |
0.8 |
-0.0 |
0.616 |
0 |
0 |
0 |
0.000 |
Average: |
2.4 |
0.1 |
0.687 |
0 |
0 |
0 |
0.000 |
45 |
57 |
|
E |
2 |
2 |
6552 |
◊ |
E |
-x,y,-z |
2_555 |
2 |
2 |
6552 |
2.4 |
0.0 |
0.623 |
0 |
0 |
0 |
0.000 |
46 |
58 |
|
D |
1 |
1 |
6488 |
◊ |
F |
x,y-1,z |
1_545 |
1 |
1 |
6514 |
0.3 |
0.0 |
0.678 |
0 |
0 |
0 |
0.000 |
|